Information card for entry 7062590

Structure parameters

• Formula: C62.5 H77.5 Cl1.5 Co3 N4 O16.5 S1.5
• Calculated formula: C62.5 H77.5 Cl1.5 Co3 N4 O16.5 S1.5
• Title of publication: Fabrication of Schottky barrier diodes utilizing carboxylate bridged trinuclear mixed valence cobalt(iii/ii/iii) complexes of tetradentate N2O2 donor reduced Schiff base ligands
• Authors of publication: Bhunia, Sudip; Das, Pubali; Banerjee, Snehasis; Gomila, Rosa M.; Drew, Michael G. B.; Frontera, Antonio; Ray, Partha Pratim; Chattopadhyay, Shouvik
• Journal of publication: New Journal of Chemistry
• Year of publication: 2023
• Journal volume: 47
• Journal issue: 30
• Pages of publication: 14202 - 14216
• a: 11.3402 ± 0.0009 Å
• b: 21.4904 ± 0.0016 Å
• c: 27.832 ± 0.002 Å
• α: 90°
• β: 93.975 ± 0.003°
• γ: 90°
• Cell volume: 6766.5 ± 0.9 ų
• Cell temperature: 273 ± 2 K
• Ambient diffraction temperature: 273 ± 2 K
• Number of distinct elements: 7
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.1323
• Residual factor for significantly intense reflections: 0.0734
• Weighted residual factors for significantly intense reflections: 0.1783
• Weighted residual factors for all reflections included in the refinement: 0.2145
• Goodness-of-fit parameter for all reflections included in the refinement: 1.017
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No